6-[1-(2,6-dimethylmorpholin-4-yl)-1-oxo-3-phenylpropan-2-yl]-1-(prop-2-en-1-yl)-4-[2-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Chemical Structure Depiction of
6-[1-(2,6-dimethylmorpholin-4-yl)-1-oxo-3-phenylpropan-2-yl]-1-(prop-2-en-1-yl)-4-[2-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
6-[1-(2,6-dimethylmorpholin-4-yl)-1-oxo-3-phenylpropan-2-yl]-1-(prop-2-en-1-yl)-4-[2-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Compound characteristics
| Compound ID: | V025-8044 |
| Compound Name: | 6-[1-(2,6-dimethylmorpholin-4-yl)-1-oxo-3-phenylpropan-2-yl]-1-(prop-2-en-1-yl)-4-[2-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione |
| Molecular Weight: | 582.62 |
| Molecular Formula: | C31 H33 F3 N4 O4 |
| Smiles: | CC1CN(CC(C)O1)C(C(Cc1ccccc1)N1CC2=C(C(c3ccccc3C(F)(F)F)NC(N2CC=C)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0904 |
| logD: | 4.002 |
| logSw: | -4.332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.387 |
| InChI Key: | IQUCEGPHWFGNQL-UHFFFAOYSA-N |